3-(naphthalen-1-ylmethylsulfanyl)-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one

Systemtic Name: 3-(naphthalen-1-ylmethylsulfanyl)-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one Openeye Name: 3-(1-naphthylmethylsulfanyl)-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one CAS Name: 3-mercapto-3-(1-naphthalenylmethylthio)-1-phenyl-2-(1-pyridin-1-iumyl)-2-propen-1-one IUPAC Name: 3-(naphthalen-1-ylmethylsulfanyl)-1-phenyl-2-pyridin-1-ium-1-yl-3-sulfanylprop-2-en-1-one Traditional Name: 3-mercapto-3-(1-naphthylmethylthio)-1-phenyl-2-pyridin-1-ium-1-yl-prop-2-en-1-one Formula: C25H20NOS2+ MolecularWeight: 414.5624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(=C(S)SCC2=CC=CC3=CC=CC=C32)[N+]4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(=C(S)SCC2=CC=CC3=CC=CC=C32)[N+]4=CC=CC=C4

InChI

InChI=1S/C25H19NOS2/c27-24(20-11-3-1-4-12-20)23(26-16-7-2-8-17-26)25(28)29-18-21-14-9-13-19-10-5-6-15-22(19)21/h1-17H,18H2/p+1